2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide

C19H26N6O — CID 163356185

IUPAC2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide
SMILESCc1cc(N2CCN(c3ccc(NC(=O)C(C)(C)C)nc3)CC2)ncn1
InChIInChI=1S/C19H26N6O/c1-14-11-17(22-13-21-14)25-9-7-24(8-10-25)15-5-6-16(20-12-15)23-18(26)19(2,3)4/h5-6,11-13H,7-10H2,1-4H3,(H,20,23,26)
InChIKeyYMHDJFZLIPNLGC-UHFFFAOYSA-N
MW354.46 g/mol
LogP2.49
Rot. Bonds3

About 2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide

2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide (PubChem CID 163356185) has the molecular formula C19H26N6O and a molecular weight of 354.46 g/mol. Its IUPAC name is 2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide
PubChem CID163356185
Molecular FormulaC19H26N6O
Molecular Weight354.46 g/mol
Exact Mass354.22
IUPAC Name2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide
SMILESCc1cc(N2CCN(c3ccc(NC(=O)C(C)(C)C)nc3)CC2)ncn1
InChIInChI=1S/C19H26N6O/c1-14-11-17(22-13-21-14)25-9-7-24(8-10-25)15-5-6-16(20-12-15)23-18(26)19(2,3)4/h5-6,11-13H,7-10H2,1-4H3,(H,20,23,26)
InChIKeyYMHDJFZLIPNLGC-UHFFFAOYSA-N
XLogP2.49
TPSA74.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.46
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,2-dimethyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propanamide
CID 47215724
2,2-dimethyl-N-[5-[4-(2-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide
CID 163356186
N-[5-[4-(5-chloropyrimidin-2-yl)piperazin-1-yl]-2-pyridinyl]-2,2-dimethylpropanamide
CID 163356470
2,2-dimethyl-N-[5-[4-(2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide
CID 163356599
N-[5-[4-(6-ethyl-5-fluoropyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]-2,2-dimethylpropanamide
CID 163356577
N-[5-[4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-2-pyridinyl]-2,2-dimethylpropanamide
CID 163357235
2,2-dimethyl-1-[4-(6-methylpyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one
CID 171335437
N-[6-[4-(4-fluorophenyl)piperazin-1-yl]pyridazin-3-yl]-2,2-dimethylpropanamide
CID 113043147
4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methylpyrimidine
CID 163353209
6-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]quinazoline
CID 126894296
4-methyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzamide
CID 32947923
4-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]sulfonylbenzoic acid
CID 108781305

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide (CID 163356185) is 2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide is Cc1cc(N2CCN(c3ccc(NC(=O)C(C)(C)C)nc3)CC2)ncn1.
What is the InChIKey of 2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide?
The InChIKey is YMHDJFZLIPNLGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N6O/c1-14-11-17(22-13-21-14)25-9-7-24(8-10-25)15-5-6-16(20-12-15)23-18(26)19(2,3)4/h5-6,11-13H,7-10H2,1-4H3,(H,20,23,26).
What are the key properties of 2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide?
2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide has a molecular weight of 354.46 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[5-[4-(6-methylpyrimidin-4-yl)piperazin-1-yl]-2-pyridinyl]propanamide is sourced from PubChem (CID 163356185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).